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trans-1-(2-Hydroxy-2-phenylethyl)-4-[(2-hydroxy-2-[2H5]phenylethyl]cyclohexane
SpectraBase Compound ID KtiQIzdL6V4
InChI InChI=1S/C22H28O2/c23-21(19-9-5-2-6-10-19)16-18-11-13-20(14-12-18)22(24)15-17-7-3-1-4-8-17/h1-10,18,20-24H,11-16H2/t18-,20-,21?,22?/i1D,3D,4D,7D,8D
InChIKey ZVADBRZBROZWNX-ZEDYNCJKSA-N
Mol Weight 329.49 g/mol
Molecular Formula C22H232D5O2
Exact Mass 329.240314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BNoZxO1vMqU
Name trans-1-(2-Hydroxy-2-phenylethyl)-4-[(2-hydroxy-2-[2H5]phenylethyl]cyclohexane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23D5O2
InChI InChI=1S/C22H28O2/c23-21(19-9-5-2-6-10-19)16-18-11-13-20(14-12-18)22(24)15-17-7-3-1-4-8-17/h1-10,18,20-24H,11-16H2/t18-,20-,21?,22?/i1D,3D,4D,7D,8D
InChIKey ZVADBRZBROZWNX-ZEDYNCJKSA-N
Molecular Weight 329.495 g/mol
SMILES OC([C@]1(CC[C@](CC(c2ccccc2)O)(CC1)[H])[H])Cc1c(c([2D])c(c(c1[2D])[2D])[2D])[2D]
SPLASH splash10-0bt9-4920000000-c273ec47f4d3514296a7
Source of Spectrum KC-0-255-0
Wiley ID 820467